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Search results for: '201-869-0'
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2-Methylbenzylamine
Cas Number: 89-93-0Formula: C8H11NMolecular weight: 121.18Synonyms: 2-methylbenzyl amine | FS-4070 | DTXSID3059000 | AP-770/40653937 | (2-Methylphenyl)methanamine # | 2...SMILES: CC1=CC=CC=C1CNInChIKey: CJAAPVQEZPAQNI-UHFFFAOYSA-NInChI: InChI=1S/C8H11N/c1-7-4-2-3-5-8(7)6-9/h2-5H,6,9H2,1H3
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Triethyl citrate
Formula: C12H20O7Molecular weight: 276.28Synonyms: TRIETHYL CITRATE|77-93-0|Ethyl citrate|Citroflex 2|Eudraflex|Hydragen CAT|Citric acid, triethyl este...SMILES: CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OInChIKey: DOOTYTYQINUNNV-UHFFFAOYSA-NInChI: InChI=1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3
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2,6-Dichlorophenol
Formula: C6H4Cl2OMolecular weight: 163Synonyms: 2,6-DICHLOROPHENOL|87-65-0|Phenol, 2,6-dichloro-|2,6-Dichlorfenol|2,6-dichlorphenol|RCRA waste numbe...SMILES: C1=CC(=C(C(=C1)Cl)O)ClInChIKey: HOLHYSJJBXSLMV-UHFFFAOYSA-NInChI: InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
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L(+)-Tartaric acid
Formula: C4H6O6Molecular weight: 150.09Synonyms: 2,3-Dihydroxybutanedioic acidSMILES: C(C(C(=O)O)O)(C(=O)O)OInChIKey: FEWJPZIEWOKRBE-JCYAYHJZSA-NInChI: InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1
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Choline bicarbonate
Formula: C5H14NO · HCO3Molecular weight: 165.19SMILES: C[N+](C)(C)CCO.C(=O)(O)[O-]InChIKey: DQKGOGJIOHUEGK-UHFFFAOYSA-MInChI: InChI=1S/C5H14NO.CH2O3/c1-6(2,3)4-5-7;2-1(3)4/h7H,4-5H2,1-3H3;(H2,2,3,4)/q+1;/p-1
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Theobromine
Formula: C7H8N4O2Molecular weight: 180.16Synonyms: DivK1c_000611 | NSC757407 | Spectrum4_000403 | KBio2_005569 | Prestwick_1054 | BSPBio_000947 | THEOB...SMILES: CN1C=NC2=C1C(=O)NC(=O)N2CInChIKey: YAPQBXQYLJRXSA-UHFFFAOYSA-NInChI: InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)
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Sulfachloropyridazine
Formula: C10H9ClN4O2SMolecular weight: 284.72Synonyms: sulfachlorpyridazine | 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamideSMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=NN=C(C=C2)ClInChIKey: XOXHILFPRYWFOD-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)
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3,4,5-Trimethoxycinnamic acid
Formula: C12H14O5Molecular weight: 238.24Synonyms: 3,4,5-TRIMETHOXYCINNAMIC ACID|90-50-6|20329-98-0|O-Methylsinapic acid|3-(3,4,5-trimethoxyphenyl)acry...SMILES: COC1=CC(=CC(=C1OC)OC)C=CC(=O)OInChIKey: YTFVRYKNXDADBI-SNAWJCMRSA-NInChI: InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+
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2-Nitrobiphenyl
Cas Number: 86-00-0Formula: C12H9NO2Molecular weight: 199.21Synonyms: 2-Nitro-1,1'-biphenyl | DTXCID505746 | mononitrobiphenyl | ONB | W-104071 | WLN: WNR BR | AKOS015833...SMILES: C1=CC=C(C=C1)C2=CC=CC=C2[N+](=O)[O-]InChIKey: YOJKKXRJMXIKSR-UHFFFAOYSA-NInChI: InChI=1S/C12H9NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
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1-Methylnaphthalene
Formula: C11H10Molecular weight: 142.2Synonyms: 1-MN | 1-methylnaphtalene | AMY38999 | CAS-90-12-0 | DTXSID9020877 | NCGC00091700-02 | NCGC00259317-...SMILES: CC1=CC=CC2=CC=CC=C12InChIKey: QPUYECUOLPXSFR-UHFFFAOYSA-NInChI: InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3
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o-Anisidine
Formula: C7H9NOMolecular weight: 123.16Synonyms: 2-Methoxyaniline | 2-METHOXY-ANILINE | 2-methoxyphenylamine | 2-Methoxy-phenylamine | o-Methoxyanili...SMILES: COC1=CC=CC=C1NInChIKey: VMPITZXILSNTON-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
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5-[(tert-butoxy)carbonyl]-5-azaspiro[2.3]hexane-4-carboxylic acid
Cas Number: 1822561-92-1 EC Number: 869-406-0Formula: C11H17NO4Molecular weight: 227.26Synonyms: 5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.3]hexane-6-carboxylic acid | 5-(tert-Butoxycarbony...SMILES: CC(C)(C)OC(=O)N1CC2(C1C(=O)O)CC2InChIKey: VEXHVXDUXUEPFT-UHFFFAOYSA-NInChI: InChI=1S/C11H17NO4/c1-10(2,3)16-9(15)12-6-11(4-5-11)7(12)8(13)14/h7H,4-6H2,1-3H3,(H,13,14)
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2-Furoic acid
Formula: C5H4O3Molecular weight: 112.08Synonyms: 2-FUROIC ACID|Furan-2-carboxylic acid|88-14-2|2-Furancarboxylic acid|Pyromucic acid|2-Carboxyfuran|F...SMILES: C1=COC(=C1)C(=O)OInChIKey: SMNDYUVBFMFKNZ-UHFFFAOYSA-NInChI: InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
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1-Chloroanthraquinone
Formula: C14H7ClO2Molecular weight: 242.66Synonyms: 1-Chloroanthraquinone, 98% | .alpha.-Chloroanthraquinone | 1-chloranylanthracene-9,10-dione | F87551...SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)ClInChIKey: BOCJQSFSGAZAPQ-UHFFFAOYSA-NInChI: InChI=1S/C14H7ClO2/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7H
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Carbazole
Formula: C12H9NMolecular weight: 167.21Synonyms: 9-H-carbazole | 9H-Carbazole | C3722 | Dibenzo(b,d)pyrrole | CAS-86-74-8 | HSDB 2164 | DTXSID4020248...SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2InChIKey: UJOBWOGCFQCDNV-UHFFFAOYSA-NInChI: InChI=1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H
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1,4,5,8-Tetrahydroxy anthraquinone
Formula: C14H8O6Molecular weight: 272.21Synonyms: 1,5,8-Ltoa | 5,8,9,10-Tetrahydroxy-1,4-anthraquinone | 4,8,9,10-tetra-hydroxy-1,5-anthraquinone | FT...SMILES: C1=CC(=C2C(=C1O)C(=O)C3=C(C=CC(=C3C2=O)O)O)OInChIKey: SOGCSKLTQHBFLP-UHFFFAOYSA-NInChI: InChI=1S/C14H8O6/c15-5-1-2-6(16)10-9(5)13(19)11-7(17)3-4-8(18)12(11)14(10)20/h1-4,15-18H
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6-Amino-1-naphthalenesulfonic Acid
Cas Number: 81-05-0Formula: C10H9NO3SMolecular weight: 223.25Synonyms: W-104220 | SY050719 | AC-14167 | 6-Amino-1-naphthalenesulfonic acid | 6-Amino-1-naphthalenesulfonic ...SMILES: C1=CC2=C(C=CC(=C2)N)C(=C1)S(=O)(=O)OInChIKey: YUNBHHWDQDGWHC-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO3S/c11-8-4-5-9-7(6-8)2-1-3-10(9)15(12,13)14/h1-6H,11H2,(H,12,13,14)
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Anthraquinone
Formula: C14H8O2Molecular weight: 208.21Synonyms: ANTHRAQUINONE|84-65-1|anthracene-9,10-dione|9,10-Anthraquinone|9,10-Anthracenedione|Anthradione|9,10...SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=OInChIKey: RZVHIXYEVGDQDX-UHFFFAOYSA-NInChI: InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H
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Solvent Red 52
SMILES: CC1=CC=C(C=C1)NC2=C3C4=C(C=C2)N(C(=O)C=C4C5=CC=CC=C5C3=O)CInChIKey: VJUKWPOWHJITTP-UHFFFAOYSA-NInChI: InChI=1S/C24H18N2O2/c1-14-7-9-15(10-8-14)25-19-11-12-20-22-18(13-21(27)26(20)2)16-5-3-4-6-17(16)24(28)23(19)22/h3-13,25H,1-2H3
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Phthalide
Formula: C8H6O2Molecular weight: 134.13Synonyms: DTXSID0052594 | HY-W015820 | NCGC00357058-01 | PHTHALIDE | 1-Phthalanone | Tox21_303762 | W-104026 |...SMILES: C1C2=CC=CC=C2C(=O)O1InChIKey: WNZQDUSMALZDQF-UHFFFAOYSA-NInChI: InChI=1S/C8H6O2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2
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Tiglic acid
Formula: C5H8O2Molecular weight: 100.12Synonyms: TIGLIC ACID|80-59-1|Tiglinic acid|Cevadic acid|2-methylbut-2-enoic acid|trans-2,3-Dimethylacrylic ac...SMILES: CC=C(C)C(=O)OInChIKey: UIERETOOQGIECD-ONEGZZNKSA-NInChI: InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)/b4-3+
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N-Nitrosodiphenylamine
Formula: C12H10N2OMolecular weight: 198.22Synonyms: N-NITROSODIPHENYLAMINE|86-30-6|Diphenylnitrosamine|Benzenamine, N-nitroso-N-phenyl-|Nitrosodiphenyla...SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)N=OInChIKey: UBUCNCOMADRQHX-UHFFFAOYSA-NInChI: InChI=1S/C12H10N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
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Dibucaine
Formula: C20H29N3O2Molecular weight: 343.46Synonyms: Cincainum | Cinchocaine | Cinchocaine [INN] | D04AB02 | DIBUCAINE (USP IMPURITY) | Dibucaine 1% | Ci...SMILES: CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN(CC)CCInChIKey: PUFQVTATUTYEAL-UHFFFAOYSA-NInChI: InChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)
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